| SpectraBase Compound ID | I8dSj0H0se2 |
|---|---|
| InChI | InChI=1S/C39H36N4O6/c1-46-30-17-13-28(14-18-30)39(27-11-7-4-8-12-27,29-15-19-31(47-2)20-16-29)48-24-34-33(44)23-35(49-34)43-25-41-36-32(21-22-40-37(36)43)42-38(45)26-9-5-3-6-10-26/h3-22,25,33-35,44H,23-24H2,1-2H3,(H,40,42,45)/t33-,34+,35+/m0/s1 |
| InChIKey | DLXZOTBUKYKKGI-BMPTZRATSA-N |
| Mol Weight | 656.7 g/mol |
| Molecular Formula | C39H36N4O6 |
| Exact Mass | 656.263485 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EtfR7wMJ6v4 |
|---|---|
| Name | DLXZOTBUKYKKGI-BMPTZRATSA-N |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H36N4O6 |
| InChI | InChI=1S/C39H36N4O6/c1-46-30-17-13-28(14-18-30)39(27-11-7-4-8-12-27,29-15-19-31(47-2)20-16-29)48-24-34-33(44)23-35(49-34)43-25-41-36-32(21-22-40-37(36)43)42-38(45)26-9-5-3-6-10-26/h3-22,25,33-35,44H,23-24H2,1-2H3,(H,40,42,45)/t33-,34+,35+/m0/s1 |
| InChIKey | DLXZOTBUKYKKGI-BMPTZRATSA-N |
| Literature Reference Author | F.SEELA,T.WENZEL |
| Literature Reference Citation | HETEROCYCLES,36,237(1993) |
| Literature Reference DOI | 10.3987/COM-92-6214 |
| Molecular Weight | 656.738 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCP7661 |